8-hydroxy-trans-neoxanthin

8-hydroxy-<i>trans</i>-neoxanthin




Chemical Formula:
C40H58O5
Molecular Weight:
618.895 Daltons
Monoisotopic Mass:
618.4284249723 Daltons
SMILES:
CC(C=CC=C(C)[CH]=C=C1(C(O)(C)CC(O)CC(C)(C)1))=CC=CC=C(C)C=CC=C(C)C(O)CC23(C(C)(C)CC(O)CC(C)(O2)3)
InChI:
1S/C40H58O5/c1-28(17-13-18-30(3)21-22-35-36(5,6)23-32(41)25-38(35,9)44)15-11-12-16-29(2)19-14-20-31(4)34(43)27-40-37(7,8)24-33(42)26-39(40,10)45-40/h11-21,32-34,41-44H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t22?,32-,33-,34?,38+,39+,40-/m0/s1
InChIKey:
NHHQDASYEZCPCF-MQLBMUGZSA-N

Databases
MetaCyc:  CPD-20696
PubChem (CID):  100959306