ID: 45214
SMILES:C12C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 45215
SMILES:C(C)(C1Oc2cc(O)cc(CCCCCC)c2)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -14.685
InChIKey:DSVKLSBRJVKPFS-UHFFFAOYSA-N
ID: 45216
SMILES:C1C2(O)C(=CC=CC(C)(O)C)C(=O)CCC2(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -16.162
InChIKey:WKHNETOTXNMOAI-UHFFFAOYSA-N
ID: 45217
SMILES:C1(=O)c2c(c(O)cc(C)c2O)C2C(C1(C)C)CC=C(CCC=C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.129
InChIKey:OICVZVUOKSUJRE-UHFFFAOYSA-N
ID: 45218
SMILES:c1c(C)c(CCC(C)C=C)c2c(c1O)C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.374
InChIKey:JYKVBCADUZOHEV-UHFFFAOYSA-N
ID: 45219
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(CCC=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: 45220
SMILES:C(CC(C)=CCC1C(C)=CCCC1=C)Cc1cc(O)ccc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -14.765
InChIKey:WYVGUKHIMVVGID-UHFFFAOYSA-N
ID: 45221
SMILES:Oc1c(-c2c(O)c(O)c(O)cc2CC2C(O)=CC(=O)C(CC=C(C)CCC=C(C)C)C2(C)C)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 672.859
CB1 binding score: -14.922
InChIKey:GOFBGKPEXPCTIH-UHFFFAOYSA-N
ID: 45222
SMILES:C(CC(CCc1cc(O)c(C)cc1O)C(=O)O)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.591
InChIKey:WMBWQLRWETUGHB-UHFFFAOYSA-N
ID: 45223
SMILES:C(C)(C)=CCCC1(C)C2CCC(C)=CC2c2c(cccc2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.737
InChIKey:FPZYCXNAPMMTPT-UHFFFAOYSA-N
ID: 45224
SMILES:CC1(C)CCCC(C)C1Cc1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -16.73
InChIKey:LFNLNJKNARBCQJ-UHFFFAOYSA-N
ID: 45225
SMILES:COc1c(O)c(CCCCC)c(C(=O)O)c(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.119
InChIKey:WTOMIPOAAHTGAI-UHFFFAOYSA-N
ID: 45226
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2=C1C(CC(C)C)C1(C)CCC(C(C(=O)O)C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.302
InChIKey:IICMDOGTDSGXSU-UHFFFAOYSA-N
ID: 45227
SMILES:CC1(C)C(c2cc(CC(C)CCCCCC)cc(O)c2C2C=C(C)CCC2C(CCC=C(C)C)C)OC(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.841
CB1 binding score: -13.128
InChIKey:XJHWNYNYOVABJS-UHFFFAOYSA-N
ID: 45228
SMILES:CC(=CCOc1c2c(cc(O)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.386
InChIKey:ZPTHLYLTXFVQAR-UHFFFAOYSA-N
ID: 45229
SMILES:CC1(C)Oc2cc(C)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 45230
SMILES:CC1(C)CC2C(C(C)(O)C)C34C(C)(CC2O1)CCC(c1c3c(O)cc(CCCCC)c1)O4
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.13
InChIKey:FAEHVBYOKDSETR-UHFFFAOYSA-N
ID: 45231
SMILES:C1(C=O)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 45232
SMILES:CC1OC(Oc2cc(C)c(O)cc2CC=C(C)CCC=C(C)C)C(OC(C)=O)C(OC(=O)C)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -14.041
InChIKey:SWXOEFBHEQRRKZ-UHFFFAOYSA-N
ID: 45233
SMILES:C1(C)=CCC2C(C1)c1c(O)cc(CCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 45234
SMILES:C1(CCC(O)C)=CCC(c2cc(O)ccc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.015
InChIKey:GUMUWAHFEVFIGJ-UHFFFAOYSA-N