ID: 65374
SMILES:C1CCC2(C)Oc3c(c(O)cc(CCC)c3)C2C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.047
InChIKey:HXIPKPZRBIFBSQ-UHFFFAOYSA-N
ID: 65375
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 65376
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.441
InChIKey:TUQZDGULHPICQO-UHFFFAOYSA-N
ID: 65377
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CO)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.583
InChIKey:AFSGVVWOXYAPKB-UHFFFAOYSA-N
ID: 65378
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1OC(C)(CC1)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.043
InChIKey:QFOKKEAZCQHLEF-UHFFFAOYSA-N
ID: 65379
SMILES:C(C=C(C)C)CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.601
InChIKey:JXEWSPILIYHMCP-UHFFFAOYSA-N
ID: 65380
SMILES:C(CCC)Cc1cc(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: 65381
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.388
InChIKey:RRFGBNZCKQNCSH-UHFFFAOYSA-N
ID: 65382
SMILES:O1c2cc(CCCCC)c(C(OC)=O)c(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 65383
SMILES:C1(=O)C(C)=CC2C(C1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.318
CB1 binding score: -16.822
InChIKey:DMWVASKIZHYTIO-UHFFFAOYSA-N
ID: 65384
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -17.628
InChIKey:FZPZZJPSHOYKIF-UHFFFAOYSA-N
ID: 65385
SMILES:OCC(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.73
InChIKey:FBBFEPQMPCGJHT-UHFFFAOYSA-N
ID: 65386
SMILES:Cc1c(CCCCCC)c2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: Not available
InChIKey:KCCVLFROCJHEMC-UHFFFAOYSA-N
ID: 65387
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(C=O)c(C=O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -16.362
InChIKey:CUKCXRKUMGPSHZ-UHFFFAOYSA-N
ID: 65388
SMILES:C1CC2C(C)(C3c4c(c(C#C)c(CCCCC)cc4O)O2)C1CC(C)=CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -15.896
InChIKey:XVNJNKJRYNYVJB-UHFFFAOYSA-N
ID: 65389
SMILES:O(c1c(CC)cc(O)c(CC=C(C)CCC=C(C)C)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.34
InChIKey:IHRZTEGOAQBLCW-UHFFFAOYSA-N
ID: 65390
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2(C)CCC3CC(C(C)(C)O)CCC3(C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -12.373
InChIKey:BBJWMUZMLZBZKL-UHFFFAOYSA-N
ID: 65391
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C3C(CCC1(C)O2)C(C)(O)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.678
InChIKey:XYCMOONFFMHOMU-UHFFFAOYSA-N
ID: 65392
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(OC)cc(O)c3C(C)=O)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.61
InChIKey:DFNJXWSLBRDAQJ-UHFFFAOYSA-N
ID: 65393
SMILES:c12c(occ1C)-c1cccc(C)c1CC21Oc2c(c(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.647
CB1 binding score: -14.077
InChIKey:AQYZRFCPKCDREB-UHFFFAOYSA-N
ID: 65394
SMILES:CC12CCC3C(C)(C)Oc4c(c(O)cc(CCCCC)c4)C3COC(C)=CCC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.015
InChIKey:WVQQBQPWEYLCBQ-UHFFFAOYSA-N