ID: 40195
SMILES:c1(O)c(OC(C)=O)cc(CCCCC)cc1OC1=C(C(C)C)CCC2(C)C3CC(C1=O)C23C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.066
InChIKey:WMTFJRBNESEAOR-UHFFFAOYSA-N
ID: 40196
SMILES:c1c(OC)c(C(C)CC)c(-c2c3c(c(O)cc2)C2C(C(C)(C)O3)CC3C(C)(CCC=C(C)C3)O2)c(OC(C)=O)c1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.801
CB1 binding score: -15.058
InChIKey:GJVMPZAKABCADZ-UHFFFAOYSA-N
ID: 40197
SMILES:C1(C)(O)C=C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.296
InChIKey:FZAGTOJLWTUWJG-UHFFFAOYSA-N
ID: 40198
SMILES:C(CCCc1cc(O)cc(O)c1)c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -13.63
InChIKey:NAZPGAUPZCUTBY-UHFFFAOYSA-N
ID: 40199
SMILES:O(c1cc(CCCCC)cc2c1C1C(C(C)(C)O2)Oc2c(c(O)cc(O)c2-c2c(OC)cc(O)c(CC=C(C(=O)CC=C(CCC=C(C)C)CO)C)c2)O1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 756.933
CB1 binding score: -15.98
InChIKey:YMEDEAQRZYJAEQ-UHFFFAOYSA-N
ID: 40200
SMILES:COc1c2c(cc(C(O)COC(CCCCCCCCCCCCCCCCCCC)=O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 612.936
CB1 binding score: -15.588
InChIKey:HBULUFZTNDVWMJ-UHFFFAOYSA-N
ID: 40201
SMILES:CCC(C(=O)c1cc2c(cc1C)OC(C)(C)C(O)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.153
InChIKey:QBMHDYCCANVKKT-UHFFFAOYSA-N
ID: 40202
SMILES:ClC12C(C)(CCCC1(C)C)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.876
CB1 binding score: -15.561
InChIKey:XKHIXLYTCCSBJZ-UHFFFAOYSA-N
ID: 40203
SMILES:C1(=O)C2(c3c(cc(CCCCC)cc3O)O1)C(=O)C(O)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -12.14
InChIKey:SLBFHAJUNQHMKE-UHFFFAOYSA-N
ID: 40204
SMILES:O=C(C)CC1C(C(C)=C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.111
InChIKey:HRAQIGAYKWNYPW-UHFFFAOYSA-N
ID: 40205
SMILES:c1(OC)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.172
InChIKey:ZLMHDSKDPRIBDQ-UHFFFAOYSA-N
ID: 40206
SMILES:O1C(C(C)=CC(OC=CC)=O)C(C)(C)C(O)CCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -15.271
InChIKey:ZTYKRSDZNZAMQR-UHFFFAOYSA-N
ID: 40207
SMILES:O1C2(C)C1CC1(c3c(cc(CCCCC)c(O)c3O)OC1(C)C)CCC=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.147
InChIKey:IEVAQHNSEDRNSD-UHFFFAOYSA-N
ID: 40208
SMILES:C1(C(C)=C)C(c2c(OC)ccc(CC[N+](O)(C)C)c2)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.492
CB1 binding score: -17.083
InChIKey:APHOZERXLQQVOV-UHFFFAOYSA-N
ID: 40209
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2C1CC(O)C(O)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -17.005
InChIKey:AXJOEUXJCVCGPB-UHFFFAOYSA-N
ID: 40210
SMILES:C(CCC)c1cc2c(cc1)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.123
InChIKey:LRVDBKYOEWVUPI-UHFFFAOYSA-N
ID: 40211
SMILES:C1(C)(C)Oc2cc(CCc3ccccc3)cc(O)c2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 40212
SMILES:C1(C)C2C(C)(C(=O)C(C(C(C)=C)C(c3ccc(O)cc3)=O)C2)Oc2c(cc(CCCCC)cc2O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.64
CB1 binding score: -15.15
InChIKey:UWLKEPQNJQLLNF-UHFFFAOYSA-N
ID: 40213
SMILES:OC1C(O)C(CO)OC(Oc2ccc3c(c2CCCCC)OC(C)(C)C2CC(=O)C(C)=C32)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.566
CB1 binding score: -13.821
InChIKey:UMMZOKNYVZILHK-UHFFFAOYSA-N
ID: 40214
SMILES:CC1COc2c(c(O)cc(CCCCCC)c2)C2C1CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.123
InChIKey:CEXJGZDTQJOALI-UHFFFAOYSA-N
ID: 40215
SMILES:C=C(C(Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -15.76
InChIKey:QTCMRDDNFFTDBX-UHFFFAOYSA-N