ID: 77302
SMILES:c1c(CCCCC)cc2c(c1O)CC1C(C)(O2)OCC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.309
InChIKey:KDUKIGLIQHUZNE-UHFFFAOYSA-N
ID: 77303
SMILES:CC(=CCc1c(O)cc(CCC)cc1O)C(CC=C(C)C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.172
InChIKey:LORJZFSTSFQWBQ-UHFFFAOYSA-N
ID: 77304
SMILES:c1(C)c2c(ccc1)-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -17.926
InChIKey:JUYGZFFPQIBMLX-UHFFFAOYSA-N
ID: 77305
SMILES:CC1=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: 77306
SMILES:O(c1ccccc1)c1cc(CCCC)cc2c1OC(C)(C)C1CCC(C=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.523
CB1 binding score: -17.196
InChIKey:UTJPHZDWZGEZBV-UHFFFAOYSA-N
ID: 77307
SMILES:c1(O)cc(CCCC)cc2c1OC(C)(C)C1CC=C(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.009
InChIKey:PHKKEGRZTZZLAI-UHFFFAOYSA-N
ID: 77308
SMILES:C1=CC(=O)C(C)C2(C)CC(O)C(C)=C3C(c4c(O)cc(CCCCC)cc4O3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -16.142
InChIKey:PHWSKYZVJUGNLW-UHFFFAOYSA-N
ID: 77309
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(C(O)C)cc2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.788
InChIKey:DOAHWRVAZZLKAP-UHFFFAOYSA-N
ID: 77310
SMILES:c12c(c(OC)cc(C)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -17.579
InChIKey:UEXVDOATPCCQRD-UHFFFAOYSA-N
ID: 77311
SMILES:CC1CC(O)C(O)C(CO)(CO)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.443
CB1 binding score: -16.063
InChIKey:PGCWAAOVZYKDPT-UHFFFAOYSA-N
ID: 77312
SMILES:C(C1Oc2cc(CCCCC)cc(O)c2C2C(C)(O)CCC12)(c1cc(O)ccc1O)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.509
CB1 binding score: -14.766
InChIKey:WMFGMGFVEGPIKY-UHFFFAOYSA-N
ID: 77313
SMILES:COc1c(C)cc2c(c1)C(C)(C)Oc1c(CCCCC)cc(O)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.094
InChIKey:IMBMJEIEWUJDON-UHFFFAOYSA-N
ID: 77314
SMILES:C(CCCc1cc(OC)c(=O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.17
InChIKey:VWAVDUXOUKWPHC-UHFFFAOYSA-N
ID: 77315
SMILES:O1c2cc(O)c(C(OC)=O)c(C)c2C2C=C(C)CCC2C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.929
InChIKey:XZVFNSSEQCWSPN-UHFFFAOYSA-N
ID: 77316
SMILES:CC1=CC(c2c(O)cc(CCCCCO)cc2OC2OC(CO)C(O)C(O)C2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: Not available
InChIKey:XJIGRODXSHNMKT-UHFFFAOYSA-N
ID: 77317
SMILES:Oc1cc2c(cc1)OC(C)(C)C1C2C=C(CCC(O)=O)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.187
InChIKey:MFSXOPPULSVIJT-UHFFFAOYSA-N
ID: 77318
SMILES:C1C2(C(C(C)C)C(OC(=O)C)C(O)C3(C)Oc4c(c(O)cc(CCCCCCCC)c4)C23)CCC1C(C=O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.741
CB1 binding score: -16.443
InChIKey:VTYRPZPPBARSSY-UHFFFAOYSA-N
ID: 77319
SMILES:C12CCC(C)CC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.571
InChIKey:YXYUFQADKYZXBS-UHFFFAOYSA-N
ID: 77320
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.781
InChIKey:CTZSPTCATADZMP-UHFFFAOYSA-N
ID: 77321
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 77322
SMILES:C1(CO)=CC2C(CC1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N