U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H28O6
Molecular Weight 328.4006
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SUPICULISPORIC ACID

SMILES

CCCCCCCCCC[C@H](C(O)=O)[C@@]1(CCC(=O)O1)C(O)=O

InChI

InChIKey=TUXHHVJPGQUPCF-DYVFJYSZSA-N
InChI=1S/C17H28O6/c1-2-3-4-5-6-7-8-9-10-13(15(19)20)17(16(21)22)12-11-14(18)23-17/h13H,2-12H2,1H3,(H,19,20)(H,21,22)/t13-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C17H28O6
Molecular Weight 328.4006
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: GO:0016507
Sources: DOI: 10.5650/jos.53.387
PubMed

PubMed

TitleDatePubMed
Molecular and crystal structure of spiculisporic acid and correlation with the surface activity.
2013
Spiculisporic acid analogues of the marine-derived fungus, Aspergillus candidus strain HDf2, and their antibacterial activity.
2015 Jul
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:06:13 GMT 2023
Edited
by admin
on Sat Dec 16 09:06:13 GMT 2023
Record UNII
DKW7X62M6X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SUPICULISPORIC ACID
Common Name English
2-FURANACETIC ACID, 2-CARBOXY-.ALPHA.-DECYLTETRAHYDRO-5-OXO-, (.ALPHA.S,2S)-
Systematic Name English
2-FURANACETIC ACID, 2-CARBOXY-.ALPHA.-DECYLTETRAHYDRO-5-OXO-, (S-(R*,R*))-
Systematic Name English
(-)-SPICULISPORIC ACID
Systematic Name English
NSC-244387
Code English
(.ALPHA.S,2S)-2-CARBOXY-.ALPHA.-DECYLTETRAHYDRO-5-OXO-2-FURANACETIC ACID
Systematic Name English
2-FURANACETIC ACID, 2-CARBOXY-.ALPHA.-DECYLTETRAHYDRO-5-OXO-
Systematic Name English
Code System Code Type Description
CAS
11040-88-3
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
SUPERSEDED
CAS
65759-98-0
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID6041135
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY
PUBCHEM
73448
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY
CAS
469-77-2
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY
CAS
1414-33-1
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
SUPERSEDED
WIKIPEDIA
Spiculisporic acid
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY
NSC
244387
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY
FDA UNII
DKW7X62M6X
Created by admin on Sat Dec 16 09:06:13 GMT 2023 , Edited by admin on Sat Dec 16 09:06:13 GMT 2023
PRIMARY