ANHYDROVINBLASTINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C46H56N4O8
Molecular Weight	792.9588
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](OC(C)=O)[C@]2(CC)C=CC3)C(=O)OC)[C@]6(C[C@H]7C[N@](CC(CC)=C7)CCC8=C6NC9=CC=CC=C89)C(=O)OC

InChI

InChIKey=FFRFGVHNKJYNOV-ZCIMLLHDSA-N

InChI=1S/C46H56N4O8/c1-8-28-21-29-24-45(41(52)56-6,37-31(15-19-49(25-28)26-29)30-13-10-11-14-34(30)47-37)33-22-32-35(23-36(33)55-5)48(4)39-44(32)17-20-50-18-12-16-43(9-2,38(44)50)40(58-27(3)51)46(39,54)42(53)57-7/h10-14,16,21-23,29,38-40,47,54H,8-9,15,17-20,24-26H2,1-7H3/t29-,38-,39+,40+,43+,44+,45-,46-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C46H56N4O8
Molecular Weight	792.9588
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:37:52 UTC 2023` Edited by `admin` on `Fri Dec 15 15:37:52 UTC 2023`
Record UNII	5B622U08B3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ANHYDROVINBLASTINE

Common Name

English

(+)-ANHYDROVINBLASTINE

Common Name

English

VINCALEUKOBLASTINE, 3',4'-DIDEHYDRO-4'-DEOXY-

Common Name

English

3',4'-DIDEHYDROISOLEUROSINE

Common Name

English

F-81097

Code

English

Classification Tree Code System Code

NCI_THESAURUS

C67422