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Details

Stereochemistry UNKNOWN
Molecular Formula C25H39NO6
Molecular Weight 449.5803
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ASPOCHALASIN L

SMILES

[H][C@]12[C@H](CC(C)C)NC(=O)[C@]13C(=O)CC(OC)C(O)C(O)CC\C(C)=C\[C@@]3([H])[C@@H](O)C(C)=C2C

InChI

InChIKey=SEJALNVFDONJGO-GXVMMTHKSA-N
InChI=1S/C25H39NO6/c1-12(2)9-17-21-14(4)15(5)22(29)16-10-13(3)7-8-18(27)23(30)19(32-6)11-20(28)25(16,21)24(31)26-17/h10,12,16-19,21-23,27,29-30H,7-9,11H2,1-6H3,(H,26,31)/b13-10+/t16-,17-,18?,19?,21-,22-,23?,25+/m0/s1

HIDE SMILES / InChI

Molecular Formula C25H39NO6
Molecular Weight 449.5803
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 5 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:17:07 GMT 2023
Edited
by admin
on Sat Dec 16 10:17:07 GMT 2023
Record UNII
SV5K9D2538
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ASPOCHALASIN L
Common Name English
1H-CYCLOUNDEC(D)ISOINDOLE-1,15(2H)-DIONE, 3,3A,6,6A,9,10,11,12,13,14-DECAHYDRO-6,11,12-TRIHYDROXY-13-METHOXY-4,5,8-TRIMETHYL-3-(2-METHYLPROPYL)-, (3S,3AR,6R,6AR,7E,15AR)-
Systematic Name English
Code System Code Type Description
CAS
861136-81-4
Created by admin on Sat Dec 16 10:17:07 GMT 2023 , Edited by admin on Sat Dec 16 10:17:07 GMT 2023
PRIMARY
PUBCHEM
11396751
Created by admin on Sat Dec 16 10:17:07 GMT 2023 , Edited by admin on Sat Dec 16 10:17:07 GMT 2023
PRIMARY
FDA UNII
SV5K9D2538
Created by admin on Sat Dec 16 10:17:07 GMT 2023 , Edited by admin on Sat Dec 16 10:17:07 GMT 2023
PRIMARY