IEJIMALIDE D FREE ACID

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C41H60N2O10S
Molecular Weight	772.988
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CO[C@H]1CCC=C(C)\C=C\C[C@H](OC)\C=C(C)\C=C\[C@@H](C)\C=C(C)\C(=O)O[C@@H]([C@@H](C)\C=C\C=C\1)C(\C)=C\C=C(/C)CNC(=O)[C@H](COS(O)(=O)=O)NC=O

InChI

InChIKey=JDMSJZXIYXZTTL-CLRFZDQZSA-N

InChI=1S/C41H60N2O10S/c1-29-14-12-18-36(50-8)17-11-10-16-33(5)39(34(6)23-22-32(4)26-42-40(45)38(43-28-44)27-52-54(47,48)49)53-41(46)35(7)24-30(2)20-21-31(3)25-37(51-9)19-13-15-29/h10-11,13-17,20-25,28,30,33,36-39H,12,18-19,26-27H2,1-9H3,(H,42,45)(H,43,44)(H,47,48,49)/b15-13+,16-10+,17-11+,21-20+,29-14-,31-25+,32-22+,34-23+,35-24+/t30-,33+,36-,37+,38+,39+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

IEJIMALIDE D FREE ACID

Common Name

English

IEJIMALIDE D ACID, (-)-

Systematic Name

English

PROPANAMIDE, N-((2E,4E)-5-((2S,3S,4E,6E,8S,11Z,13E,16S,17E,19E,21R,22E)-8,16-DIMETHOXY-3,12,18,21,23-PENTAMETHYL-24-OXOOXACYCLOTETRACOSA-4,6,11,13,17,19,22-HEPTAEN-2-YL)-2-METHYL-2,4-HEXADIEN-1-YL)-2-(FORMYLAMINO)-3-(SULFOOXY)-, (2S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

566RX56N69

Created by admin on Sat Dec 16 19:12:00 GMT 2023 , Edited by admin on Sat Dec 16 19:12:00 GMT 2023

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CAS

780005-85-8

Created by admin on Sat Dec 16 19:12:00 GMT 2023 , Edited by admin on Sat Dec 16 19:12:00 GMT 2023

PRIMARY

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