ID: 80641
SMILES:C=CC(C)(CCC(C)(c1c(O)c(C(=O)O)c(CCCCC)cc1O)OC(=O)C1(C)CCC=C(C)C1C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.675
CB1 binding score: -16.023
InChIKey:XWOCZCHLIXZISD-UHFFFAOYSA-N
ID: 80642
SMILES:CC(C)=CCC1C(C)C(C(C)c2cc(OC)c(C)cc2O)OC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.563
InChIKey:MOWIZUGJYJBLPN-UHFFFAOYSA-N
ID: 80643
SMILES:OC1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.108
InChIKey:PPZWAHLWZVOCDJ-UHFFFAOYSA-N
ID: 80644
SMILES:CC(C1CCC2(C)OC2C1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.987
InChIKey:OGYVNNJNQUCMPG-UHFFFAOYSA-N
ID: 80645
SMILES:C1C(O)(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 80646
SMILES:C(CC)Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.204
InChIKey:HWELGGINPNNRMC-UHFFFAOYSA-N
ID: 80647
SMILES:O1c2c(c(OC(C)=O)cc(CCCCC)c2)C2C(C=C(C)C)CC(C)C3CCC1(C)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.507
InChIKey:RPGJEFZIUYIWCY-UHFFFAOYSA-N
ID: 80648
SMILES:C(Cc1cc(O)c(CC=C(CCC2=C(C)CCCC2(C)C)C)c(O)c1)CCCCCCCCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.738
CB1 binding score: -14.293
InChIKey:HVWFDUOVFMREKG-UHFFFAOYSA-N
ID: 80649
SMILES:NCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)C(O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 305.418
CB1 binding score: -14.971
InChIKey:RDXDCCCGIMHART-UHFFFAOYSA-N
ID: 80650
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -16.782
InChIKey:MFRBWFPAXZBXOG-UHFFFAOYSA-N
ID: 80651
SMILES:C(C)CCc1c(C(=O)O)c2c(c3c1OC(C)(C)C=C3)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.541
InChIKey:CMUPLLONYSQMHP-UHFFFAOYSA-N
ID: 80652
SMILES:O(C(C)=O)C1CC(C)(C)Oc2ccc(CCCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.605
InChIKey:ZFXZZRNNHWADJV-UHFFFAOYSA-N
ID: 80653
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2OC)C(C(C)(C)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -18.309
InChIKey:KQWJMEAIWXADAY-UHFFFAOYSA-N
ID: 80654
SMILES:c12c(nc(CO)cc1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 259.349
CB1 binding score: -14.255
InChIKey:YLFAXLCOTMPZNI-UHFFFAOYSA-N
ID: 80655
SMILES:OC(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -18.309
InChIKey:KYBSQVMEBKBMOK-UHFFFAOYSA-N
ID: 80656
SMILES:C(=C(C1=CC2C(Oc3c2c(O)cc(CCCCC)c3)CC1(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.41
InChIKey:GVZREWSANPYION-UHFFFAOYSA-N
ID: 80657
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 80658
SMILES:c12cc(CCCCCC)cc(O)c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.225
InChIKey:IKCVLRKLCFLAPB-UHFFFAOYSA-N
ID: 80659
SMILES:C1C=C(C)COc2c(c(O)cc(CCCCC)c2)C2C(C(C)C)CCC(=C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.128
InChIKey:ZPNCQCDYDJYCJP-UHFFFAOYSA-N
ID: 80660
SMILES:C1(Cc2c(O)cc(CCCC)cc2O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.481
InChIKey:XOTQZAZRRPOSNW-UHFFFAOYSA-N
ID: 80661
SMILES:CC1CCCC23C(O2)(c2c(O)cc(CCCCC)cc2O3)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.473
InChIKey:VPVSPNUDGKULKS-UHFFFAOYSA-N