ID: 136669
SMILES:C(=O)(CC(C)C)CC(C)=CCCC1(C)Oc2cc(CCc3ccccc3)cc(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -15.789
InChIKey:KKBIHJHPWLUHGT-UHFFFAOYSA-N
ID: 136670
SMILES:O1c2cc(C)cc(O)c2C2C(C(C)(C)O)CC(C1C)CC2CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.744
InChIKey:UXJYLZNCNBPNSC-UHFFFAOYSA-N
ID: 136671
SMILES:Oc1c2c(C)cc(O)c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.932
InChIKey:GILFENBNRAGMEI-UHFFFAOYSA-N
ID: 136672
SMILES:C1(O)CC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.751
InChIKey:LPHUJWFUPRMKJU-UHFFFAOYSA-N
ID: 136673
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 136674
SMILES:C1=C(C)CCC2C1c1c(c(C(CC(C)C)=O)c(O)c(C(C(CC)C)=O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 428.569
CB1 binding score: -14.076
InChIKey:KANZYAVMGRMMDL-UHFFFAOYSA-N
ID: 136675
SMILES:C(CC)Cc1c(O)cc2c(c1)OC(C)(C)C1C2CC(COC(=O)CCCCCCCCCCCCCCC)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.856
CB1 binding score: -15.929
InChIKey:PWZFCRBRZREUNC-UHFFFAOYSA-N
ID: 136676
SMILES:Cc1cc(O)c2c3c1OC(C)(C)C(O3)C(O)CC(C)=CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.791
InChIKey:SREAYUGRWRPGOC-UHFFFAOYSA-N
ID: 136677
SMILES:C(Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C(C)(O)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.766
InChIKey:KUOVZMMQYJLQHO-UHFFFAOYSA-N
ID: 136678
SMILES:CC1CCC(C(C)(C)O)CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -15.284
InChIKey:TXFYXSZXQMVVPP-UHFFFAOYSA-N
ID: 136679
SMILES:C12CCC(C)(O)C1Cc1c(O)cc(CCCC(=O)C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.585
InChIKey:WYZTZVNYNJMVTM-UHFFFAOYSA-N
ID: 136680
SMILES:C12=C(C)CCC1C(C)(C)Oc1c2ccc(CCN(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 285.431
CB1 binding score: -15.675
InChIKey:GBWKSWUPQVOYEM-UHFFFAOYSA-N
ID: 136681
SMILES:c1(CCCC(C)C)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C(OC)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.34
InChIKey:ITOUYHVUWCIJHA-UHFFFAOYSA-N
ID: 136682
SMILES:Oc1c2c3c(c(C=Cc4ccccc4)cc(CC=C(C)C)c1O)OC(C)(C)C1C3C=C(C)CCC1(O)C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.717
CB1 binding score: -15.519
InChIKey:CPQFJRQALHIGEA-UHFFFAOYSA-N
ID: 136683
SMILES:C1(C)(C)Oc2c(c(OC)cc(CCCCC)c2)C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.511
InChIKey:FJNYRBFCDFVKTA-UHFFFAOYSA-N
ID: 136684
SMILES:c1(C2C(C(C)(C)O)CCC(C)=C2)c(O)cc(CCCC(=C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.355
InChIKey:JFQZNCATDNPSOK-UHFFFAOYSA-N
ID: 136685
SMILES:O1c2c(c(O)cc(CCCCC)c2)CC2C1=C(C)CCC2=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -11.639
InChIKey:DBOJNIZXFIPXSX-UHFFFAOYSA-N
ID: 136686
SMILES:CC1=CC(O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.567
InChIKey:URRJUSLCXVXZOX-UHFFFAOYSA-N
ID: 136687
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2CCCCC(O)=O)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 346.467
CB1 binding score: -16.544
InChIKey:YNCPQCZIOWXFAK-UHFFFAOYSA-N
ID: 136688
SMILES:c1(CC=C(C)C)c(O)c2c(cc1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.155
InChIKey:PZIRWMLUKNUAIS-UHFFFAOYSA-N
ID: 136689
SMILES:c1c(OC)c(O)c(C2CC(C)=CC(c3c(OC)ccc(CC[N+](C)(C)O)c3)C(C(=C)C)C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.642
CB1 binding score: -14.671
InChIKey:DXCKUOYYDHIABB-UHFFFAOYSA-O