(1R)-1-[(3aR,5R,6S,6aR)-6-[[(3aR,5R,6R,6aR)-2,2-dimethyl-6-phenylmethoxy-6-prop-2-enyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

Update Time: 2025-04-25 16:33:36

	Common Name	(1R)-1-[(3aR,5R,6S,6aR)-6-[[(3aR,5R,6R,6aR)-2,2-dimethyl-6-phenylmethoxy-6-prop-2-enyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol	English Name	(1R)-1-[(3aR,5R,6S,6aR)-6-[[(3aR,5R,6R,6aR)-2,2-dimethyl-6-phenylmethoxy-6-prop-2-enyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol
	CAS NO.	N/A	Molecular Weight	522.6
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₇H₃₈O₁₀	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A
	Symbol	N/A	Signal Word	N/A

Properties

English Name	(1R)-1-[(3aR,5R,6S,6aR)-6-[[(3aR,5R,6R,6aR)-2,2-dimethyl-6-phenylmethoxy-6-prop-2-enyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

Molecular Formula	C27H38O10
Molecular Weight	522.6
Exact Mass	522.24649740
LogP	1.40
Standard SMILES	C=CCC1(OCc2ccccc2)C(COC2C(C(O)CO)OC3OC(C)(C)OC32)OC2OC(C)(C)OC21
Canonical SMILES	CC1(OC2C(C(OC2O1)C(CO)O)OCC3C(C4C(O3)OC(O4)(C)C)(CC=C)OCC5=CC=CC=C5)C
Isomeric SMILES	CC1(O[C@@H]2[C@H]([C@H](O[C@@H]2O1)[C@@H](CO)O)OC[C@@H]3[C@@]([C@@H]4[C@H](O3)OC(O4)(C)C)(CC=C)OCC5=CC=CC=C5)C
Standard InChI Identifier	InChI=1S/C27H38O10/c1-6-12-27(31-14-16-10-8-7-9-11-16)18(32-24-22(27)35-26(4,5)37-24)15-30-20-19(17(29)13-28)33-23-21(20)34-25(2,3)36-23/h6-11,17-24,28-29H,1,12-15H2,2-5H3/t17-,18-,19-,20+,21-,22+,23-,24-,27-/m1/s1
Standard InChI Key	XRKPOFYHKFHFHD-MICTXAEYSA-N
Compound Complexity	798.00
computational chemistry	Hydrogen Bond Acceptor Count：10 Hydrogen Bond Donor Count：2 Rotatable Bond Count：10 Heavy Atom Count：37 Total Chiral Atom Count：9 Defined Chiral Atom Count：9 Undefined Chiral Atom Count：0 Total Chiral Bond Count：0 Defined Chiral Bond Count：0 Undefined Chiral Bond Count：0 Isotope Atom Count：0 Covalent Unit Count：1 Tautomer Count：-1 Monoisotopic Mass：522.24649740