ID: 64219
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 64220
SMILES:c12cc(CCCCC)ccc1OC(C)(C)C1(O2)CC2C(C)(O2)CCC(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.924
InChIKey:VNMTWNSALIDSEX-UHFFFAOYSA-N
ID: 64221
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17
InChIKey:CGYHWLVCHKZQHO-UHFFFAOYSA-N
ID: 64222
SMILES:Oc1cc(CNC)cc(O)c1C1C(C(=C)C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -18.939
InChIKey:WBQXQWICOAVKMI-UHFFFAOYSA-N
ID: 64223
SMILES:CCCCCc1cc(OC(=O)CC(C)C)c(O)c(C2(C)CCC(=C)C2=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -12.565
InChIKey:JZHPGDIXQFULML-UHFFFAOYSA-N
ID: 64224
SMILES:C1C(C(O)(C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.168
InChIKey:BMEOABJGGIYLGA-UHFFFAOYSA-N
ID: 64225
SMILES:C1(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 64226
SMILES:O=C(CC(C)c1cc(O)c2c(c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.45
InChIKey:VSVJNAAENBHCKV-UHFFFAOYSA-N
ID: 64227
SMILES:C1(C)=CCC2C(C1)c1c(cc(C)cc1O)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.307
CB1 binding score: -17.334
InChIKey:ZWYNFSRAUOAYNU-UHFFFAOYSA-N
ID: 64228
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 64229
SMILES:CC1(C)C=CC(C(C)=C)(Cc2cc(OC)cc(C)c2O)OO1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -14.722
InChIKey:XMQJAWXQTQONPO-UHFFFAOYSA-N
ID: 64230
SMILES:C(C)(C)CCCC(c1c(O)c(C=O)c2c(c1)C1CC(C)(CCC1=C(C)C)O2)[N+](C)(CCCCC)C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.727
CB1 binding score: -15.924
InChIKey:KQIWZQVIHZLKAZ-UHFFFAOYSA-O
ID: 64231
SMILES:C1C(C)=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.524
InChIKey:USODFRMMCODFKQ-UHFFFAOYSA-N
ID: 64232
SMILES:C(CC)(c1c(O)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC21)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.449
InChIKey:QZRFDRQFYHSCLN-UHFFFAOYSA-N
ID: 64233
SMILES:C(C)(C)Oc1c(C(CC(C)C)=O)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.187
InChIKey:MQIADIVRBPQCLU-UHFFFAOYSA-N
ID: 64234
SMILES:C1CC(C)(C)Oc2c1c(O)cc(CCCCC)c2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.308
InChIKey:AKJVPKKOMNLXKL-UHFFFAOYSA-N
ID: 64235
SMILES:CC1(C)Oc2c(c(O)cc(CC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 64236
SMILES:C1C2(c3c(cc(CCC)cc3O)O1)CC(C(C)=C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -13.196
InChIKey:OUQNZVZJHBPGBQ-UHFFFAOYSA-N
ID: 64237
SMILES:CC1=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -17.454
InChIKey:JOIGAAUCVYUZTJ-UHFFFAOYSA-N
ID: 64238
SMILES:CCCCC(=O)Oc1cc2c(cc1OC(C)=O)OC1(C)CCC3C(C)(CCC(C(=C)C)C3)C1C2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -13.155
InChIKey:SYVXRAKWWUTMBE-UHFFFAOYSA-N
ID: 64239
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N