8,8-dihydroxy-trans-neoxanthin

8,8-dihydroxy-<i>trans</i>-neoxanthin




Chemical Formula:
C40H58O6
Molecular Weight:
634.895 Daltons
Monoisotopic Mass:
634.4233395944 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)(O)CC23(C(C)(C)CC(O)CC(C)(O2)3)
InChI:
1S/C40H58O6/c1-28(17-13-18-30(3)21-22-34-35(5,6)23-32(41)25-37(34,9)43)15-11-12-16-29(2)19-14-20-31(4)39(44,45)27-40-36(7,8)24-33(42)26-38(40,10)46-40/h11-21,32-33,41-45H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t22?,32-,33-,37+,38+,40-/m0/s1
InChIKey:
VUJDOYVYDZTBFH-ZSLFKWPESA-N

Databases
MetaCyc:  CPD-20697
PubChem (CID):  131841478