β-D-glucuronosyl-(1→4)-α-D-galacturonosyl-(1→4)-β-D-glucuronosyl-(1→4)-β-D-glucosyl-(C55 ω-saturated dolichyl phosphate)
Chemical Formula:
C79H125O27P
Molecular Weight:
1537.814 Daltons
Monoisotopic Mass:
1540.8458854476 Daltons
SMILES:
CC(C)CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(CCOP(=O)(OC1(C(C(C(C(O1)CO)OC4(OC(C(=O)[O-])C(OC3(OC(C(=O)[O-])C(OC2(OC(C(=O)[O-])C(O)C(O)C(O)2))C(O)C(O)3))C(O)C(O)4))O)O))[O-])C
InChI:
1S/C79H129O27P/c1-46(2)23-13-24-47(3)25-14-26-48(4)27-15-28-49(5)29-16-30-50(6)31-17-32-51(7)33-18-34-52(8)35-19-36-53(9)37-20-38-54(10)39-21-40-55(11)41-22-42-56(12)43-44-98-107(96,97)106-79-66(89)60(83)67(57(45-80)99-79)100-77-64(87)61(84)69(71(104-77)74(92)93)102-78-65(88)62(85)68(72(105-78)75(94)95)101-76-63(86)58(81)59(82)70(103-76)73(90)91/h25,27,29,31,33,35,37,39,41,46,56-72,76-89H,13-24,26,28,30,32,34,36,38,40,42-45H2,1-12H3,(H,90,91)(H,92,93)(H,94,95)(H,96,97)/p-4/b47-25+,48-27+,49-29-,50-31-,51-33-,52-35-,53-37-,54-39-,55-41-/t56?,57-,58+,59+,60-,61-,62-,63-,64-,65-,66-,67-,68-,69+,70+,71+,72+,76-,77-,78+,79+/m1/s1
InChIKey:
Synonyms
- β-D-GlcA-(1→4)-α-D-GalA-(1→4)-β-D-GlcA-(1→4)-β-D-Glc-DolP
Databases
MetaCyc:
CPD-17890
MetaNetX:
MNXM148104