ID: 70456
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 70457
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CC=C(C)C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.334
InChIKey:YNNFYMQFHNFBDP-UHFFFAOYSA-N
ID: 70458
SMILES:C1(C(C)=C)CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.508
InChIKey:AQQBSDKJMYSUAC-UHFFFAOYSA-N
ID: 70459
SMILES:C1(C)=C2C(c3c(O)cc(CCCCCO)cc3OC2(C)C)C=C(C(=O)OC)CCC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -14.094
InChIKey:RVTCGZWXTHEADX-UHFFFAOYSA-N
ID: 70460
SMILES:CC1(C)C2CCC(C)=CC2c2c(OC)cc(CC)c(C(O)=O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.151
InChIKey:LBXRGYVJDVWDMQ-UHFFFAOYSA-N
ID: 70461
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.898
InChIKey:SUVXTOCRTNYFMQ-UHFFFAOYSA-N
ID: 70462
SMILES:C1(C)=CC2C(CC1(O)C)C(C)(C)Oc1c(c(C)ccc1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.022
InChIKey:WVUPJYXFQSAKJM-UHFFFAOYSA-N
ID: 70463
SMILES:C1(C)CC2C(C(C)(C)Oc3c(O)c(CC=O)cc(O)c32)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -15.619
InChIKey:HVFIRKNSDCATDF-UHFFFAOYSA-N
ID: 70464
SMILES:Oc1c(C(=O)C(CC)C)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.078
InChIKey:ZJYYXCGFEUARDG-UHFFFAOYSA-N
ID: 70465
SMILES:C(C(O)C(O)CC(C)c1cc(O)c(C2C=C(C)CCC2C(=CCC=C(C)C)C)c(O)c1)OCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -15.191
InChIKey:ILYRJSDTBNIVJN-UHFFFAOYSA-N
ID: 70466
SMILES:C1(=O)C2=CC(O)C(C)CC3C(C(C)=C)CC(C)(C1)Oc1c2c(O)cc(CCCCC)c31
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -16.813
InChIKey:YSVLFYNDQVSZNY-UHFFFAOYSA-N
ID: 70467
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C1(CCC=C(C)C)CO1)C2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.981
InChIKey:ZWKSNABZRMPLIG-UHFFFAOYSA-N
ID: 70468
SMILES:Oc1cc(CCCCC)cc(O)c1CC=C(C)CCC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 70469
SMILES:C1C(C)C2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.334
InChIKey:HSWXHBKVRHCSJK-UHFFFAOYSA-N
ID: 70470
SMILES:c12c(O)cc(CCCCCO)cc1OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.031
InChIKey:MSIHCQAPVYVMLV-UHFFFAOYSA-N
ID: 70471
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 70472
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C(O)=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 70473
SMILES:C(CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 70474
SMILES:CC1(C)CC(OS(Cl)(=O)=O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.967
CB1 binding score: -15.22
InChIKey:WYHDIJNSWMBDLU-UHFFFAOYSA-N
ID: 70475
SMILES:C(CCCC)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C(=O)CCc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.631
CB1 binding score: -17.125
InChIKey:DKNZYZGHBMPGSC-UHFFFAOYSA-N
ID: 70476
SMILES:O=C(C)Oc1c2c(cc(C)c1)OC(C(C)(CCC=C(CCC=C(C)C)C)O)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.069
InChIKey:AFWWVKUIAGVNLC-UHFFFAOYSA-N