Cyclocrassostreaxanthin A

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C40H56O5
Molecular Weight	616.8696
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	8
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]1C[C@H](CC(C)=O)O[C@@]1(C)CC(=O)C(\C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\[C@@]23O[C@@H](CC2(C)C)C[C@@]3(C)O

InChI

InChIKey=YCHOPPKXFCUQHM-YTVYXYHESA-N

InChI=1S/C40H56O5/c1-28(17-13-18-30(3)21-22-40-37(7,8)25-35(45-40)26-39(40,10)43)15-11-12-16-29(2)19-14-20-31(4)36(42)27-38(9)32(5)23-34(44-38)24-33(6)41/h11-22,32,34-35,43H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t32-,34-,35+,38+,39-,40-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,2R,4S)-2-Hydroxy-2,6,6-trimethyl-7-oxabicyclo[2.2.1]hept-1-yl]-3,7,12,16-tetramethyl-1-[(2S,3R,5R)-tetrahydro-2,3-dimethyl-5-(2-oxopropyl)-2-furanyl]-3,5,7,9,11,13,15,17-octadecaoctaen-2-one

Preferred Name

English

Cyclocrassostreaxanthin A

Common Name

English

3,5,7,9,11,13,15,17-Octadecaoctaen-2-one, 18-[(1R,2R,4S)-2-hydroxy-2,6,6-trimethyl-7-oxabicyclo[2.2.1]hept-1-yl]-3,7,12,16-tetramethyl-1-[(2S,3R,5R)-tetrahydro-2,3-dimethyl-5-(2-oxopropyl)-2-furanyl]-, (3E,5E,7E,9E,11E,13E,15E,17E)-

Systematic Name

English

Code System Code Type Description

CAS

256505-51-8

Created by admin on Wed Apr 02 07:05:11 GMT 2025 , Edited by admin on Wed Apr 02 07:05:11 GMT 2025

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EPA CompTox

DTXSID501098100

Created by admin on Wed Apr 02 07:05:11 GMT 2025 , Edited by admin on Wed Apr 02 07:05:11 GMT 2025

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FDA UNII

CN8A777SPJ

Created by admin on Wed Apr 02 07:05:11 GMT 2025 , Edited by admin on Wed Apr 02 07:05:11 GMT 2025

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PUBCHEM

10865038

Created by admin on Wed Apr 02 07:05:11 GMT 2025 , Edited by admin on Wed Apr 02 07:05:11 GMT 2025

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SUBSTANCE RECORD


					CN8A777SPJ

Cyclocrassostreaxanthin A