Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C42H62O16.H3N |
Molecular Weight | 839.9626 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 19 / 19 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N.[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]3(C)C2=CC(=O)[C@]4([H])[C@@]5(C)CC[C@H](O[C@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O[C@@H]7O[C@@H]([C@@H](O)[C@H](O)[C@H]7O)C(O)=O)C(O)=O)C(C)(C)[C@]5([H])CC[C@@]34C)C(O)=O
InChI
InChIKey=ILRKKHJEINIICQ-OOFFSTKBSA-N
InChI=1S/C42H62O16.H3N/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);1H3/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+;/m0./s1
Molecular Formula | C42H62O16 |
Molecular Weight | 822.9321 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 19 / 19 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | H3N |
Molecular Weight | 17.0305 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:49:57 UTC 2023
by
admin
on
Fri Dec 15 15:49:57 UTC 2023
|
Record UNII |
3VRD35U26C
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Related Record | Type |
---|
Name | Type | Language | ||
---|---|---|---|---|
|
Official Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Code | English | ||
|
Common Name | English |
Classification Tree | Code System | Code | ||
---|---|---|---|---|
|
DSLD |
3785 (Number of products:2)
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
35348
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
3VRD35U26C
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
53956-04-0
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
SUB11707MIG
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
SUB50039
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
3VRD35U26C
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
1311505
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | RxNorm | ||
|
53956-04-0
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
1029929
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
C45678
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
CONCEPT | Industrial Aid | ||
|
2800
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
100000091521
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
C77525
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
SUB11707MIG
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
53956-04-0
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
62074
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
53956-04-0
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY | |||
|
258-887-7
Created by
admin on Fri Dec 15 15:49:57 UTC 2023 , Edited by admin on Fri Dec 15 15:49:57 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
SUB_CONCEPT->SUBSTANCE | |||
|
SUB_CONCEPT->SUBSTANCE | |||
|
SOLVATE->ANHYDROUS |
|
||
|
SUB_CONCEPT->SUBSTANCE | |||
|
SUB_CONCEPT->SUBSTANCE |
|
||
|
SUB_CONCEPT->SUBSTANCE | |||
|
SUB_CONCEPT->SUBSTANCE |
|
||
|
SUB_CONCEPT->SUBSTANCE | |||
|
PARENT -> CONSTITUENT ALWAYS PRESENT | |||
|
SOLVATE->ANHYDROUS |
|
||
|
SUB_CONCEPT->SUBSTANCE | |||
|
PARENT -> SALT/SOLVATE |
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
IMPURITY -> PARENT |
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |
|