ID: 43534
SMILES:O(c1c2c(c(CO)cc1O)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.544
InChIKey:XIZNSOQSMHCIJC-UHFFFAOYSA-N
ID: 43535
SMILES:CC1(C)Oc2cc(O)c(C=O)cc2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.81
InChIKey:CLZZKMPGTDWPPM-UHFFFAOYSA-N
ID: 43536
SMILES:c1(O)cc(O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 43537
SMILES:CC=CCc1cc(OC(=O)C)c(C2C=C(C)CCC2C(C)(C)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.285
InChIKey:ZVWJBGPNBUFIRW-UHFFFAOYSA-N
ID: 43538
SMILES:c1(O)cc(CCCCC)ccc1CC1C(C(C)(C)O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.122
InChIKey:WTVURHYUKPKRKL-UHFFFAOYSA-N
ID: 43539
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 43540
SMILES:CC1C2(C=O)C=C(C)CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.619
InChIKey:HYKNDGMWCIVHSI-UHFFFAOYSA-N
ID: 43541
SMILES:CC1(C)C2CCC(=C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 43542
SMILES:C1(C)=CC2C(C(C)(C)Oc3c(C(CCCCCCC=CO)=O)c(C)c(O)cc32)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.827
InChIKey:CDHIGXWDDHKODY-UHFFFAOYSA-N
ID: 43543
SMILES:C1(C)(C)Oc2c(cc(O)c(C)c2)C2C1CCC(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 43544
SMILES:O1C(C)(C)C2C(c3c(OC)cccc3OC2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -16.63
InChIKey:WNNZNHUJDIAVJS-UHFFFAOYSA-N
ID: 43545
SMILES:Cc1cc2c(c(O)c1)C1CC(C)=CCC1C(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 326.48
CB1 binding score: -17.035
InChIKey:DBBSIKFPXDZOLG-UHFFFAOYSA-N
ID: 43546
SMILES:c1(CCCCC)cc2c(cc1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 43547
SMILES:c1(CCCCC)cc2c(c(O)c1)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: 43548
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCCCC)c(CC=C(C)C)c(C(CCCCC)C(O)CCC(C)=O)c3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.867
CB1 binding score: -15.439
InChIKey:PPQHKSYBCWQLKF-UHFFFAOYSA-N
ID: 43549
SMILES:C(C(O)c1c(O)cc(CCCCC)cc1O)=C(CCC=C(C)CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.305
InChIKey:OEDQGFRHPWQLNI-UHFFFAOYSA-N
ID: 43550
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(CO)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.583
InChIKey:AFSGVVWOXYAPKB-UHFFFAOYSA-N
ID: 43551
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 43552
SMILES:c1(O)cc(C(=O)C)c(CCN(C)C)c2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.494
CB1 binding score: -14.362
InChIKey:JHOWJIWWCJODMZ-UHFFFAOYSA-N
ID: 43553
SMILES:CCC=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.717
InChIKey:WWHZEOCJUSEJSW-UHFFFAOYSA-N
ID: 43554
SMILES:C(CCCC)c1cc(O)c2c(c1O)C(=O)OC(CCC=C(C)C)(C)C1CCC(=C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.697
InChIKey:DQEXAOZJZPXMDR-UHFFFAOYSA-N