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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H46N4O4
Molecular Weight 526.7106
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of HEMIASTERLIN

SMILES

CN[C@H](C(=O)N[C@H](C(=O)N(C)[C@H](\C=C(/C)C(O)=O)C(C)C)C(C)(C)C)C(C)(C)C1=CN(C)C2=C1C=CC=C2

InChI

InChIKey=KQODQNJLJQHFQV-MKWZWQCGSA-N
InChI=1S/C30H46N4O4/c1-18(2)23(16-19(3)28(37)38)34(11)27(36)25(29(4,5)6)32-26(35)24(31-9)30(7,8)21-17-33(10)22-15-13-12-14-20(21)22/h12-18,23-25,31H,1-11H3,(H,32,35)(H,37,38)/b19-16+/t23-,24-,25-/m1/s1

HIDE SMILES / InChI

Molecular Formula C30H46N4O4
Molecular Weight 526.7106
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:04:11 UTC 2023
Edited
by admin
on Sat Dec 16 08:04:11 UTC 2023
Record UNII
6S0T7U2I3F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEMIASTERLIN
Common Name English
L-VALINAMIDE, N,.BETA.,.BETA.,1-TETRAMETHYL-L-TRYPTOPHYL-N-((1S,2E)-3-CARBOXY-1-(1-METHYLETHYL)-2-BUTEN-1-YL)-N,3-DIMETHYL-
Systematic Name English
MILNAMIDE B
Common Name English
(-)-HEMIASTERLIN
Common Name English
Code System Code Type Description
CAS
157207-90-4
Created by admin on Sat Dec 16 08:04:11 UTC 2023 , Edited by admin on Sat Dec 16 08:04:11 UTC 2023
PRIMARY
FDA UNII
6S0T7U2I3F
Created by admin on Sat Dec 16 08:04:11 UTC 2023 , Edited by admin on Sat Dec 16 08:04:11 UTC 2023
PRIMARY
PUBCHEM
5352092
Created by admin on Sat Dec 16 08:04:11 UTC 2023 , Edited by admin on Sat Dec 16 08:04:11 UTC 2023
PRIMARY
Related Record Type Details
DERIVATIVE -> PARENT