methyl-O-4-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:
C80H127O27P
Molecular Weight:
1551.841 Daltons
Monoisotopic Mass:
1554.8615355118 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(OC)C(O)C(O)2))C(O)C(O)3))C(O)C(O)4))O)O))[O-])C
InChI:
1S/C80H131O27P/c1-47(2)24-14-25-48(3)26-15-27-49(4)28-16-29-50(5)30-17-31-51(6)32-18-33-52(7)34-19-35-53(8)36-20-37-54(9)38-21-39-55(10)40-22-41-56(11)42-23-43-57(12)44-45-99-108(96,97)107-80-66(89)59(82)67(58(46-81)100-80)101-77-64(87)61(84)69(72(105-77)75(92)93)103-79-65(88)62(85)70(73(106-79)76(94)95)102-78-63(86)60(83)68(98-13)71(104-78)74(90)91/h26,28,30,32,34,36,38,40,42,47,57-73,77-89H,14-25,27,29,31,33,35,37,39,41,43-46H2,1-13H3,(H,90,91)(H,92,93)(H,94,95)(H,96,97)/p-4/b48-26+,49-28+,50-30-,51-32-,52-34-,53-36-,54-38-,55-40-,56-42-/t57?,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68+,69+,70-,71+,72+,73+,77-,78-,79+,80+/m1/s1
InChIKey:
Synonyms
- methyl-O-4-β-D-GlcA-(1→4)-α-D-GalA-(1→4)-β-D-GlcA-(1→4)-β-D-Glc-DolP
Databases
MetaCyc:
CPD-17889
MetaNetX:
MNXM147526