ID: 108466
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -19.932
InChIKey:YRIJETKCLFDWJX-UHFFFAOYSA-N
ID: 108467
SMILES:C(C)(C1C(c2c(O)cc(CCC)cc2O)CC(C)=CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 108468
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)c(C=O)cc(O)c1-c1cc2c(cc1)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.544
CB1 binding score: -14.723
InChIKey:JMRVKTHWRUEVFA-UHFFFAOYSA-N
ID: 108469
SMILES:O=C(Oc1c(CCCCC)cc2c(c1O)-c1c(ccc(C)c1Br)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.369
CB1 binding score: -14.827
InChIKey:LWBGVHIVVKTABD-UHFFFAOYSA-N
ID: 108470
SMILES:C12C(OC)C(C)=CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.693
InChIKey:HYVPZTNLBCATAW-UHFFFAOYSA-N
ID: 108471
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(=C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.802
InChIKey:SCRAHYRPZPVKCS-UHFFFAOYSA-N
ID: 108472
SMILES:C1Oc2c(c(O)cc(CCCCC)c2)C2=C1C1(C)CCC(=O)C1(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -14.885
InChIKey:QDFAHYHAFQKVNE-UHFFFAOYSA-N
ID: 108473
SMILES:C1(=C=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -12.694
InChIKey:YKXLRHQXPLZYGK-UHFFFAOYSA-N
ID: 108474
SMILES:C12(C(C)(C)CCCC1(OC1OC(CO)C(O)C(O)C1O)C)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.652
CB1 binding score: -16.281
InChIKey:MOSASWRGBFBVBK-UHFFFAOYSA-N
ID: 108475
SMILES:CC1(C)Oc2c(cc(O)cc2CC=C(C)C)CC1C(=O)CCc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -15.929
InChIKey:CAYMMJSZFKULIQ-UHFFFAOYSA-N
ID: 108476
SMILES:CCCCCCc1ccc2c(c1)OC(C)(C)C1CCC(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -16.376
InChIKey:BEMDUSKZKRBFLF-UHFFFAOYSA-N
ID: 108477
SMILES:CC1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 108478
SMILES:C1(c2c(C)cc(O)c(CC=C(C)C)c2OC)C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.723
InChIKey:UDVSLDHZEUYPTI-UHFFFAOYSA-N
ID: 108479
SMILES:C(C=C(C)CCC=C(C)C)c1c(O)cc(C)c(Cl)c1Oc1cc(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Diphenyl ethers (DPEs)
Class: Cannabinoids;Fungal DPEs
MW: 457.054
CB1 binding score: -13.016
InChIKey:RKACLJFZFHHJIS-UHFFFAOYSA-N
ID: 108480
SMILES:C(=O)(OC1C2c3c(OC)cc(CCCCC)cc3OC(C)(C)C2CCC1=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.054
InChIKey:APLSAJHWKCYASR-UHFFFAOYSA-N
ID: 108481
SMILES:CC(C)C(=O)CCC(C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.664
InChIKey:YEIVQYJSVFADKA-UHFFFAOYSA-N
ID: 108482
SMILES:CC1=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 108483
SMILES:c12c(O)cc(CCCCC)cc1C1(C(=O)OC(C)(C)CCC1)C(Cl)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.913
CB1 binding score: -16.433
InChIKey:HCEQVVWXZYGBLC-UHFFFAOYSA-N
ID: 108484
SMILES:Oc1c(CC=C(CCC=C(C)C(OC)=O)C)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.502
InChIKey:LMHMHHWCJXTZFY-UHFFFAOYSA-N
ID: 108485
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 108486
SMILES:C12=CC(C)(O)CC(O)C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.809
InChIKey:CRWQEFHNNFNXDE-UHFFFAOYSA-N