ID: 45424
SMILES:C(O)C(=CCc1c2c(cc(O)c1)OC(C)(C)CC2)COC(=O)C=C(CC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -11.773
InChIKey:SWURIPZQDGKYGC-UHFFFAOYSA-N
ID: 45425
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45426
SMILES:C(O)C(CCCc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.845
InChIKey:JOFHBZGTHSGBPZ-UHFFFAOYSA-N
ID: 45427
SMILES:C(C=C(C)C)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -19.034
InChIKey:SKFPSWUXWVYQEV-UHFFFAOYSA-N
ID: 45428
SMILES:C1Cc2c(c(O)cc(CCCCC)c2)-c2c3c4c(cc21)OCC(C)=C4CC(C(C)=CC(C=C(C)C)=O)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.663
CB1 binding score: -15.18
InChIKey:IPYSOVVGBYAIEX-UHFFFAOYSA-N
ID: 45429
SMILES:C(C)C(C(=O)c1c(O)c(C=O)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 400.515
CB1 binding score: -15.986
InChIKey:SZOFLZJBZMAQNP-UHFFFAOYSA-N
ID: 45430
SMILES:CCCC(C)C(OCC(=CCCC1(C)C=Cc2c(c(C)cc(O)c2)O1)C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.545
InChIKey:KPEVQKFKBJDYSM-UHFFFAOYSA-N
ID: 45431
SMILES:CC(=CC1CC(O)(CO)c2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -16.559
InChIKey:PTTCVOUPANHEBT-UHFFFAOYSA-N
ID: 45432
SMILES:OC1CC2(C)C(=O)C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -13.07
InChIKey:UYBDEZCDNJUELM-UHFFFAOYSA-N
ID: 45433
SMILES:c12c(c(O)cc(CCCCC)c1)C1C3(C(=O)OC(C1C(=C)C)C3)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -12.391
InChIKey:RBVMVCQYGLVLJH-UHFFFAOYSA-N
ID: 45434
SMILES:CC12C(c3c(O)c(C(=O)O)c(CCCCC)cc3O)OC(CCC=C(C)CCC=C(C)C)(C)C1CC=C(C)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.768
CB1 binding score: -16.302
InChIKey:FPPFYOHTRHNEGA-UHFFFAOYSA-N
ID: 45435
SMILES:CC1(C)C2C(c3c(O)cc(CCCCC)cc3O2)CC(CO)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.435
InChIKey:TVCYQWWYNOZMCY-UHFFFAOYSA-N
ID: 45436
SMILES:O=C1C2(c3c(OC(=O)C)cc(CCCCC)cc3O1)C(=C(C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -11.282
InChIKey:BOMYIUBBDFAQSZ-UHFFFAOYSA-N
ID: 45437
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 45438
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: 45439
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 45440
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCC)c3)C1O)C(=O)C(O)=C1C2(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -14.41
InChIKey:BDECUVVUMRWAPO-UHFFFAOYSA-N
ID: 45441
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1CCC(C)C(=O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.214
InChIKey:GMOATYNAGDCFTA-UHFFFAOYSA-N
ID: 45442
SMILES:C1C2(C)CCC(C(C)C)C2C2C(C)(C1)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.823
InChIKey:PFZAMCIIUZFWQG-UHFFFAOYSA-N
ID: 45443
SMILES:c1(O)cc(CCCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 45444
SMILES:Oc1cc(O)c2c(c1)C1C(C(C)(C)O2)CC=C(CO)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -17.097
InChIKey:WXOIPNKWJFESJL-UHFFFAOYSA-N