ID: 60061
SMILES:C1=C(C)C2(O)C(C)(CC3c4c(cc(CCCCC)cc4O)OC3(C)CC2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.585
InChIKey:YXBOSXFYGFOQRH-UHFFFAOYSA-N
ID: 60062
SMILES:c1(O)c2c(c(O)c(OC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -18.436
InChIKey:CHKCVHCTDJBPRD-UHFFFAOYSA-N
ID: 60063
SMILES:C1(C)=CC(=O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 60064
SMILES:c12c(c(=O)cc(CCCC)cc1O)OC(C)(C)c1c2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -16.093
InChIKey:HTACGVVHBCYFJT-UHFFFAOYSA-N
ID: 60065
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 60066
SMILES:O=S(C)(=O)c1c(CCCCC)cc2c(c1O)C13C(=O)OC(C)(C)C1CCC3CSSC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.705
CB1 binding score: -15.233
InChIKey:UCSLYDPXSXYIDY-UHFFFAOYSA-N
ID: 60067
SMILES:C(C)(C)=C1C(c2c(O)cc(CCCCC)cc2O)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.305
InChIKey:KGMLNSJHBBOEOG-UHFFFAOYSA-N
ID: 60068
SMILES:c1c(C2C3C(C(C)(C)C24CC4)C(=O)O3)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.337
InChIKey:AFNJSSXHFSJNMZ-UHFFFAOYSA-N
ID: 60069
SMILES:Oc1c(CC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 60070
SMILES:O(C(c1cc(OC)c2c(c1)OC(C)(C)C1C[CH]C(C)=CC21)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.405
CB1 binding score: -12.406
InChIKey:GWRCDXYCVSBYTE-UHFFFAOYSA-N
ID: 60071
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 60072
SMILES:C(=C(C)C)C(OC1C2(C)C(O)C3c4c(O)cc(CCCC)cc4OC3(C)CCC2OC1=O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.551
CB1 binding score: -15.562
InChIKey:FPCCQOPMUZHQJZ-UHFFFAOYSA-N
ID: 60073
SMILES:c1(CCCCC)cc(OC)cc2c1OC1(C)C(C(OC)=O)(C2)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.57
InChIKey:XIELBKMCRWXWSO-UHFFFAOYSA-N
ID: 60074
SMILES:C1(C)C(OC(=O)C)CC(C)(C)CC1c1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -17.425
InChIKey:GVYFIZXSZDISMU-UHFFFAOYSA-N
ID: 60075
SMILES:O=C(C(OC)c1ccccc1)Oc1cc2c(cc1CCCCC)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.629
CB1 binding score: -16.376
InChIKey:INJDNVJJKSOZHM-UHFFFAOYSA-N
ID: 60076
SMILES:C1(C)=C2c3c(O)cc(CCCCC)cc3OC(C)(CCC2C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.07
InChIKey:WYGBDJBYWRZGTF-UHFFFAOYSA-N
ID: 60077
SMILES:C(C)CCCc1cc2c(c(O)c1O)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.286
InChIKey:NHNAENUOFBTILX-UHFFFAOYSA-N
ID: 60078
SMILES:C1C2C(C(CC(=CCc3c(O)c(C)cc(OC)c3)C)O)(C)C(C)CC(C(=C)C1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.829
InChIKey:WBVUEJDBTXUYIB-UHFFFAOYSA-N
ID: 60079
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O1)C1OC(=O)C(=C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.907
InChIKey:SQKPMPUQHTYMMQ-UHFFFAOYSA-N
ID: 60080
SMILES:C1C2C(CCC1)C(C)(C)Oc1cc(C)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -10.613
InChIKey:KVPCNWBYEIENFO-UHFFFAOYSA-N
ID: 60081
SMILES:c1c2c(c(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.63
InChIKey:LAYHJCJKKWVWTP-UHFFFAOYSA-N