ID: 10543
SMILES:C12=C(c3c(cc(CCOC)cc3O)OC1(C)C)C(=O)OC2(C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.368
CB1 binding score: -15.889
InChIKey:HHQSXKRDQJPEGW-UHFFFAOYSA-N
ID: 10544
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(O)c3C(=O)C(C)C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 10545
SMILES:c1c(C(=O)O)c(O)c2c(c1)OC(CCCC(C)=C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.515
InChIKey:FYMLFKRWNRHCCV-UHFFFAOYSA-N
ID: 10546
SMILES:C1(C)C(OC(C)=O)CC2(O)c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.929
InChIKey:HOCHCSBDBHMVHZ-UHFFFAOYSA-N
ID: 10547
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 10548
SMILES:C(C)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.802
InChIKey:SCRAHYRPZPVKCS-UHFFFAOYSA-N
ID: 10549
SMILES:C(CCCc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)(O)C1)C(OC(C)=O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -15.929
InChIKey:OLWGAHIZZPJBBL-UHFFFAOYSA-N
ID: 10550
SMILES:COc1c2c(cc(CCCCC)c1)OC1(C)C(O2)CC(C(O)(C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -14.564
InChIKey:CEJCSSPYPYXBBU-UHFFFAOYSA-N
ID: 10551
SMILES:O(c1cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 10552
SMILES:C1(C)(C)C2(C=CC(O)(C)O)Oc3cc(C)cc(O)c3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -11.904
InChIKey:CHYSVWNZECDXOG-UHFFFAOYSA-N
ID: 10553
SMILES:Cc1c2c(cc(C=O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -11.033
InChIKey:FSIQPRDKXCJYBL-UHFFFAOYSA-N
ID: 10554
SMILES:C(c1c(=O)c2c(cc(C(O)CC(=O)C)c1)OC(C)(C)C1CC=C(C)CC21)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -16.559
InChIKey:QWNXEHBVQGCVLG-UHFFFAOYSA-N
ID: 10555
SMILES:c1c(CCCCC)ccc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 10556
SMILES:O=C1C(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 10557
SMILES:CC1=C(C=O)C2C(CC1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -16.041
InChIKey:TVULGSZSPPRYJE-UHFFFAOYSA-N
ID: 10558
SMILES:CC(C)C1=C2C3C(C)(CCC2(C)CC1C(COC(=O)C)=C)Oc1c(c(O)cc(CCC)c1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.568
InChIKey:UVUJFAPOXXXJTH-UHFFFAOYSA-N
ID: 10559
SMILES:C1C(C)(C(Cc2cc(OC)cc(C)c2O)C)OC(C)(C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.335
InChIKey:GSSMAAZRVQYCSK-UHFFFAOYSA-N
ID: 10560
SMILES:C1C2C(CO)CCC(C(C)C)=Cc3c(c(O)c(C)c(C(O)C(C)CC)c3OC2(C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.609
InChIKey:FSPRROHNJCCEOQ-UHFFFAOYSA-N
ID: 10561
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)cc(C)c(C(O)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -18.717
InChIKey:JEXJLYDVFFARRG-UHFFFAOYSA-N
ID: 10562
SMILES:c1c(O)c(C(OCC2=CC(C(C)C)(C)CC2)=O)ccc1CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.845
InChIKey:CGNVCZPWRYVRQX-UHFFFAOYSA-N
ID: 10563
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(O)(C)CCC1C(=C)C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N